Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4u3w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N ASP 32.A O no hydrogen 2.854 N/A HIS 6.A N VAL 13.A O no hydrogen 3.031 N/A HIS 6.A NE2 SER 15.A OG no hydrogen 3.070 N/A TYR 7.A N LEU 204.A O no hydrogen 2.818 N/A TYR 7.A OH HIS 193.A ND1 no hydrogen 2.644 N/A ILE 8.A N GLU 11.A O no hydrogen 2.857 N/A ASN 9.A N ASN 203.A OD1 no hydrogen 2.981 N/A GLU 11.A N ILE 8.A O no hydrogen 3.274 N/A VAL 13.A N HIS 6.A O no hydrogen 2.993 N/A SER 15.A OG HIS 6.A NE2 no hydrogen 3.070 N/A SER 15.A OG GLU 35.A O no hydrogen 2.834 N/A PHE 19.A N VAL 33.A O no hydrogen 2.836 N/A ASN 21.A N ALA 31.A O no hydrogen 2.744 N/A ASN 21.A ND2 ASP 89.A OD1 no hydrogen 3.064 N/A SER 23.A N ARG 28.A O no hydrogen 2.844 N/A SER 23.A OG ASP 26.A OD1 no hydrogen 3.536 N/A VAL 25.A N SER 23.A OG no hydrogen 2.904 N/A ASP 26.A N SER 23.A OG no hydrogen 3.337 N/A GLY 27.A N SER 23.A O no hydrogen 2.903 N/A ARG 28.A N ASP 26.A OD1 no hydrogen 2.925 N/A ARG 28.A NH1 ASP 26.A OD1 no hydrogen 3.391 N/A ARG 28.A NH1 ASP 26.A OD2 no hydrogen 3.094 N/A LYS 29.A NZ ASP 32.A OD1 no hydrogen 2.695 N/A LYS 29.A NZ ASP 32.A OD2 no hydrogen 3.462 N/A LEU 30.A N ASN 21.A O no hydrogen 2.720 N/A ASP 32.A N GLN 2.A O no hydrogen 2.930 N/A VAL 33.A N PHE 19.A O no hydrogen 2.846 N/A CYS 34.A N LEU 4.A O no hydrogen 2.945 N/A CYS 34.A SG LEU 4.A O no hydrogen 3.490 N/A GLU 35.A N THR 17.A O no hydrogen 2.956 N/A ALA 36.A N HIS 206.A O no hydrogen 2.822 N/A LEU 40.A N ASP 37.A OD1 no hydrogen 2.957 N/A VAL 41.A N ASP 37.A O no hydrogen 2.960 N/A ASP 42.A N ALA 38.A O no hydrogen 3.035 N/A SER 43.A N ALA 39.A O no hydrogen 2.967 N/A SER 43.A OG ALA 39.A O no hydrogen 3.119 N/A ALA 44.A N LEU 40.A O no hydrogen 3.044 N/A VAL 45.A N VAL 41.A O no hydrogen 3.080 N/A GLN 46.A N ASP 42.A O no hydrogen 2.967 N/A GLN 46.A NE2 ASP 42.A OD1 no hydrogen 2.797 N/A GLN 46.A NE2 ASP 222.A OD2 no hydrogen 3.001 N/A ALA 47.A N SER 43.A O no hydrogen 3.035 N/A ALA 48.A N ALA 44.A O no hydrogen 3.020 N/A HIS 49.A N VAL 45.A O no hydrogen 2.889 N/A HIS 49.A NE2 ASP 222.A O no hydrogen 2.137 N/A ALA 50.A N GLN 46.A O no hydrogen 2.955 N/A ALA 51.A N ALA 47.A O no hydrogen 2.982 N/A GLN 52.A N ALA 48.A O no hydrogen 3.098 N/A GLN 52.A NE2 GLY 170.A O no hydrogen 2.945 N/A LYS 53.A N HIS 49.A O no hydrogen 3.503 N/A ALA 54.A N ALA 50.A O no hydrogen 2.868 N/A GLY 55.A N GLN 52.A O no hydrogen 3.204 N/A TRP 56.A N ALA 51.A O no hydrogen 3.276 N/A TRP 56.A NE1 ASN 171.A O no hydrogen 2.904 N/A ARG 57.A N GLN 52.A O no hydrogen 3.200 N/A ASP 58.A N GLY 55.A O no hydrogen 2.986 N/A THR 59.A N TRP 56.A O no hydrogen 3.295 N/A THR 59.A OG1 TRP 56.A O no hydrogen 2.813 N/A THR 60.A N GLN 63.A OE1 no hydrogen 2.825 N/A GLN 63.A N THR 60.A OG1 no hydrogen 3.033 N/A ARG 64.A N THR 60.A O no hydrogen 2.877 N/A ARG 64.A NE THR 59.A OG1 no hydrogen 2.950 N/A ALA 65.A N PRO 61.A O no hydrogen 2.803 N/A ALA 66.A N ALA 62.A O no hydrogen 2.928 N/A TRP 67.A N GLN 63.A O no hydrogen 3.067 N/A LEU 68.A N ARG 64.A O no hydrogen 2.896 N/A HIS 69.A N ALA 65.A O no hydrogen 3.028 N/A HIS 69.A NE2 ASP 114.A OD1 no hydrogen 3.242 N/A LYS 70.A N ALA 66.A O no hydrogen 3.034 N/A ILE 71.A N TRP 67.A O no hydrogen 2.919 N/A ALA 72.A N LEU 68.A O no hydrogen 2.865 N/A ASP 73.A N HIS 69.A O no hydrogen 2.887 N/A GLY 74.A N LYS 70.A O no hydrogen 2.973 N/A ILE 75.A N ILE 71.A O no hydrogen 3.078 N/A GLU 76.A N ALA 72.A O no hydrogen 3.080 N/A ALA 77.A N ASP 73.A O no hydrogen 2.898 N/A ARG 78.A N ILE 75.A O no hydrogen 2.826 N/A ARG 78.A NE GLU 81.A OE2 no hydrogen 2.863 N/A ARG 78.A NH1 GLU 190.A OE1 no hydrogen 3.032 N/A ARG 78.A NH2 GLU 81.A OE1 no hydrogen 2.778 N/A ARG 78.A NH2 GLU 190.A OE1 no hydrogen 2.850 N/A PHE 79.A N GLU 76.A O no hydrogen 3.149 N/A PHE 82.A N ARG 78.A O no hydrogen 3.105 N/A VAL 83.A N PHE 79.A O no hydrogen 2.991 N/A ALA 84.A N ASP 80.A O no hydrogen 2.991 N/A ALA 85.A N GLU 81.A O no hydrogen 3.069 N/A GLU 86.A N PHE 82.A O no hydrogen 2.994 N/A VAL 87.A N VAL 83.A O no hydrogen 2.920 N/A ALA 88.A N ALA 84.A O no hydrogen 2.879 N/A ASP 89.A N ALA 85.A O no hydrogen 3.069 N/A THR 90.A N GLU 86.A O no hydrogen 3.008 N/A THR 90.A OG1 GLU 86.A O no hydrogen 2.877 N/A GLY 91.A N VAL 87.A O no hydrogen 2.760 N/A ARG 92.A N THR 90.A OG1 no hydrogen 3.163 N/A ARG 92.A NE ASP 101.A OD2 no hydrogen 2.819 N/A ARG 92.A NH1 ASN 281.A OD1 no hydrogen 3.161 N/A GLN 96.A N PRO 93.A O no hydrogen 3.020 N/A GLN 96.A NE2 THR 324.A O no hydrogen 3.487 N/A ALA 97.A N PRO 93.A O no hydrogen 3.076 N/A ARG 98.A N VAL 94.A O no hydrogen 3.020 N/A ARG 98.A NH1.B ASP 80.A OD1 no hydrogen 2.923 N/A THR 99.A N ALA 95.A O no hydrogen 3.323 N/A THR 99.A OG1 ALA 95.A O no hydrogen 3.109 N/A LEU 100.A N GLN 96.A O no hydrogen 2.847 N/A ILE 102.A N ALA 97.A O no hydrogen 2.933 N/A ALA 103.A N ARG 98.A O no hydrogen 3.302 N/A GLY 105.A N ASP 101.A O no hydrogen 2.970 N/A ILE 106.A N ILE 102.A O no hydrogen 3.019 N/A ALA 107.A N ALA 103.A O no hydrogen 3.044 N/A ASN 108.A N ARG 104.A O no hydrogen 2.979 N/A ASN 108.A ND2 THR 160.A OG1 no hydrogen 2.861 N/A ARG 110.A N ILE 106.A O no hydrogen 3.367 N/A ARG 110.A NH1 HIS 69.A ND1 no hydrogen 3.162 N/A ARG 110.A NH1 ASP 73.A OD1 no hydrogen 3.028 N/A ARG 110.A NH2 ASP 73.A OD1 no hydrogen 2.879 N/A ARG 110.A NH2 GLU 76.A OE2.B no hydrogen 3.235 N/A THR 111.A N ALA 107.A O no hydrogen 2.809 N/A THR 111.A OG1 ALA 107.A O no hydrogen 2.974 N/A PHE 112.A N ASN 108.A O no hydrogen 3.194 N/A ALA 113.A N PHE 109.A O no hydrogen 2.997 N/A ASP 114.A N ARG 110.A O no hydrogen 3.038 N/A LEU 115.A N THR 111.A O no hydrogen 2.974 N/A VAL 116.A N PHE 112.A O no hydrogen 3.158 N/A ARG 117.A N ALA 113.A O no hydrogen 3.306 N/A ARG 117.A NH2 ASP 114.A OD1 no hydrogen 2.776 N/A THR 118.A N ASP 114.A O no hydrogen 3.328 N/A THR 118.A OG1 ASP 114.A O no hydrogen 3.376 N/A THR 118.A OG1 LEU 115.A O no hydrogen 3.487 N/A ALA 119.A N LEU 115.A O no hydrogen 2.959 N/A TYR 123.A OH GLU 125.A OE2 no hydrogen 2.615 N/A PHE 124.A N ASN 136.A O no hydrogen 3.027 N/A THR 126.A N LEU 134.A O no hydrogen 2.913 N/A ALA 128.A N SER 132.A O no hydrogen 2.979 N/A GLY 131.A N ALA 128.A O no hydrogen 3.021 N/A SER 132.A N ASP 130.A OD1 no hydrogen 3.090 N/A SER 132.A OG ASP 130.A OD1 no hydrogen 2.652 N/A GLU 133.A N ALA 485.A O no hydrogen 2.923 N/A LEU 134.A N THR 126.A O no hydrogen 2.925 N/A ILE 135.A N VAL 482.A O no hydrogen 2.881 N/A ASN 136.A N PHE 124.A O no hydrogen 2.863 N/A ASN 136.A ND2 PHE 124.A O no hydrogen 3.164 N/A ASN 136.A ND2 THR 126.A OG1 no hydrogen 2.847 N/A TYR 137.A N VAL 480.A O no hydrogen 2.909 N/A VAL 138.A N GLU 122.A O no hydrogen 3.062 N/A THR 139.A N THR 478.A O no hydrogen 2.794 N/A THR 139.A OG1.A THR 478.A O no hydrogen 3.495 N/A ARG 140.A NE ASP 472.A OD1 no hydrogen 2.803 N/A ARG 140.A NH2 ASP 472.A OD1 no hydrogen 2.918 N/A LYS 141.A N GLU 476.A O no hydrogen 3.083 N/A GLY 144.A N ASN 171.A OD1 no hydrogen 2.926 N/A VAL 145.A N SER 224.A OG no hydrogen 3.040 N/A ILE 146.A N CYS 172.A O no hydrogen 2.866 N/A GLY 147.A N ALA 225.A O no hydrogen 2.881 N/A ILE 148.A N VAL 174.A O no hydrogen 2.946 N/A ILE 149.A N THR 227.A O no hydrogen 3.142 N/A SER 150.A N LYS 176.A O no hydrogen 3.238 N/A ASN 153.A ND2 GLN 284.A O no hydrogen 3.104 N/A LEU 156.A N GLU 86.A OE2 no hydrogen 2.817 N/A LEU 158.A N LEU 154.A O no hydrogen 2.984 N/A PHE 159.A N PRO 155.A O no hydrogen 3.138 N/A THR 160.A N LEU 156.A O no hydrogen 2.984 N/A THR 160.A OG1 GLY 105.A O no hydrogen 3.539 N/A THR 160.A OG1 LEU 156.A O no hydrogen 3.156 N/A THR 160.A OG1 LEU 157.A O no hydrogen 3.023 N/A TRP 161.A N LEU 157.A O no hydrogen 2.988 N/A TRP 161.A NE1 GLU 252.A OE2 no hydrogen 3.121 N/A LYS 162.A N PHE 159.A O no hydrogen 3.125 N/A LYS 162.A NZ THR 227.A OG1 no hydrogen 2.890 N/A LYS 162.A NZ THR 229.A OG1 no hydrogen 2.909 N/A VAL 163.A N PHE 159.A O no hydrogen 2.902 N/A ALA 164.A N THR 160.A O no hydrogen 2.915 N/A ALA 166.A N LYS 162.A O no hydrogen 3.102 N/A LEU 167.A N VAL 163.A O no hydrogen 2.944 N/A ALA 168.A N ALA 164.A O no hydrogen 2.854 N/A MET 169.A N PRO 165.A O no hydrogen 3.063 N/A GLY 170.A N LEU 167.A O no hydrogen 3.015 N/A ASN 171.A N ALA 166.A O no hydrogen 3.123 N/A ASN 171.A ND2 ALA 166.A O no hydrogen 2.964 N/A ASN 171.A ND2 TYR 474.A O no hydrogen 2.805 N/A CYS 172.A N GLY 144.A O no hydrogen 2.874 N/A CYS 172.A SG ALA 48.A O no hydrogen 3.430 N/A VAL 173.A N VAL 201.A O no hydrogen 2.796 N/A VAL 174.A N ILE 146.A O no hydrogen 3.066 N/A ALA 175.A N ASN 203.A O no hydrogen 2.894 N/A LYS 176.A N ILE 148.A O no hydrogen 2.744 N/A LYS 176.A NZ PRO 177.A O no hydrogen 2.912 N/A LYS 176.A NZ GLU 179.A OE1 no hydrogen 3.315 N/A LYS 176.A NZ GLY 207.A O no hydrogen 2.635 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.765 N/A GLU 180.A N SER 178.A OG no hydrogen 3.110 N/A THR 181.A N SER 178.A O no hydrogen 3.054 N/A SER 183.A N ASP 89.A OD2 no hydrogen 2.876 N/A SER 183.A OG ASP 89.A OD1 no hydrogen 2.764 N/A SER 183.A OG ASP 89.A OD2 no hydrogen 3.113 N/A SER 184.A OG GLU 86.A OE1 no hydrogen 2.765 N/A THR 186.A N PRO 182.A O no hydrogen 3.206 N/A THR 186.A OG1 PRO 182.A O no hydrogen 2.770 N/A THR 186.A OG1 HIS 206.A NE2 no hydrogen 2.936 N/A LEU 187.A N SER 183.A O no hydrogen 3.050 N/A LEU 188.A N SER 184.A O no hydrogen 2.893 N/A ALA 189.A N ALA 185.A O no hydrogen 2.995 N/A GLU 190.A N THR 186.A O no hydrogen 3.063 N/A VAL 191.A N LEU 187.A O no hydrogen 2.984 N/A MET 192.A N LEU 188.A O no hydrogen 2.883 N/A HIS 193.A N ALA 189.A O no hydrogen 2.949 N/A HIS 193.A ND1 TYR 7.A OH no hydrogen 2.644 N/A ASP 194.A N GLU 190.A O no hydrogen 2.776 N/A VAL 195.A N VAL 191.A O no hydrogen 2.908 N/A GLY 196.A N HIS 193.A O no hydrogen 3.043 N/A LEU 197.A N MET 192.A O no hydrogen 3.113 N/A VAL 201.A N PRO 198.A O no hydrogen 3.204 N/A ASN 203.A N VAL 173.A O no hydrogen 2.932 N/A ASN 203.A ND2 VAL 173.A O no hydrogen 3.024 N/A ASN 203.A ND2 GLY 200.A O no hydrogen 2.936 N/A LEU 204.A N TYR 7.A O no hydrogen 2.760 N/A ILE 205.A N ALA 175.A O no hydrogen 3.032 N/A HIS 206.A N HIS 6.A ND1 no hydrogen 2.893 N/A HIS 206.A NE2 THR 186.A OG1 no hydrogen 2.936 N/A HIS 208.A N GLU 35.A OE2 no hydrogen 2.973 N/A HIS 208.A ND1 GLU 35.A OE1 no hydrogen 2.808 N/A ASN 211.A N GLU 215.A OE2 no hydrogen 2.866 N/A ALA 212.A N GLY 209.A O no hydrogen 2.983 N/A GLY 214.A N HIS 208.A O no hydrogen 2.969 N/A GLU 215.A N GLY 209.A O no hydrogen 3.184 N/A PHE 216.A N ALA 212.A O no hydrogen 2.995 N/A LEU 217.A N ALA 213.A O no hydrogen 3.022 N/A THR 218.A N GLY 214.A O no hydrogen 3.224 N/A THR 218.A OG1 GLU 215.A O no hydrogen 2.666 N/A ARG 219.A N GLU 215.A O no hydrogen 3.176 N/A HIS 220.A N LEU 217.A O no hydrogen 3.159 N/A HIS 220.A NE2 ASP 42.A OD1 no hydrogen 2.658 N/A ASP 222.A N HIS 220.A ND1 no hydrogen 2.877 N/A ILE 223.A N HIS 220.A O no hydrogen 3.502 N/A SER 224.A N VAL 145.A O no hydrogen 2.841 N/A SER 224.A OG LEU 143.A O no hydrogen 3.195 N/A SER 224.A OG VAL 145.A O no hydrogen 3.563 N/A ILE 226.A N GLU 248.A O no hydrogen 2.917 N/A THR 227.A N GLY 147.A O no hydrogen 2.925 N/A THR 227.A OG1 GLU 465.A OE2 no hydrogen 2.953 N/A PHE 228.A N SER 250.A O no hydrogen 2.905 N/A THR 229.A OG1 GLU 252.A OE1 no hydrogen 2.846 N/A GLY 230.A N GLU 252.A O no hydrogen 2.908 N/A SER 232.A OG LEU 459.A O no hydrogen 2.835 N/A GLY 235.A N GLU 231.A O no hydrogen 3.049 N/A SER 236.A N SER 232.A O no hydrogen 3.050 N/A SER 236.A OG SER 232.A O no hydrogen 3.433 N/A THR 237.A N ARG 233.A O no hydrogen 3.130 N/A THR 237.A OG1 ARG 233.A O no hydrogen 3.233 N/A ILE 238.A N THR 234.A O no hydrogen 2.962 N/A MET 239.A N GLY 235.A O no hydrogen 2.973 N/A LYS 240.A N SER 236.A O no hydrogen 3.194 N/A ALA 241.A N THR 237.A O no hydrogen 2.952 N/A VAL 242.A N ILE 238.A O no hydrogen 2.971 N/A ALA 243.A N LYS 240.A O no hydrogen 3.156 N/A GLY 245.A N VAL 242.A O no hydrogen 3.160 N/A VAL 246.A N ALA 243.A O no hydrogen 2.965 N/A LYS 247.A N VAL 242.A O no hydrogen 3.378 N/A LYS 247.A NZ PRO 221.A O no hydrogen 2.769 N/A LYS 247.A NZ ILE 223.A O no hydrogen 2.825 N/A GLU 248.A N SER 224.A O no hydrogen 3.300 N/A VAL 249.A N GLU 248.A OE1 no hydrogen 2.961 N/A SER 250.A N ILE 226.A O no hydrogen 3.026 N/A SER 250.A OG GLU 465.A OE2 no hydrogen 2.664 N/A PHE 251.A N LEU 462.A O no hydrogen 3.065 N/A GLU 252.A N PHE 228.A O no hydrogen 3.021 N/A LEU 253.A N SER 460.A O no hydrogen 2.853 N/A GLY 254.A N SER 232.A OG no hydrogen 3.044 N/A GLY 255.A N GLU 388.A OE2 no hydrogen 3.092 N/A LYS 256.A NZ GLU 290.A OE1 no hydrogen 2.779 N/A LYS 256.A NZ CYS 384.A O no hydrogen 3.173 N/A LYS 256.A NZ GLU 387.A O no hydrogen 2.707 N/A ASN 257.A ND2 CYS 286.A O no hydrogen 2.685 N/A ASN 257.A ND2 CYS 288.A O no hydrogen 3.043 N/A ALA 259.A N ARG 291.A O no hydrogen 2.966 N/A VAL 260.A N SER 419.A O no hydrogen 2.788 N/A VAL 261.A N TYR 293.A O no hydrogen 2.849 N/A PHE 262.A N TRP 421.A O no hydrogen 3.081 N/A ALA 263.A N GLU 295.A OE1 no hydrogen 2.846 N/A ALA 265.A N PHE 262.A O no hydrogen 2.961 N/A ALA 269.A N ASP 266.A OD1 no hydrogen 3.201 N/A ALA 270.A N ASP 266.A O no hydrogen 2.973 N/A VAL 271.A N PHE 267.A O no hydrogen 2.981 N/A ALA 272.A N ASP 268.A O no hydrogen 3.109 N/A GLY 273.A N ALA 269.A O no hydrogen 2.849 N/A VAL 274.A N ALA 270.A O no hydrogen 2.933 N/A LEU 275.A N VAL 271.A O no hydrogen 2.941 N/A ARG 276.A N ALA 272.A O no hydrogen 3.068 N/A ARG 276.A NH1 TRP 445.A O no hydrogen 2.869 N/A SER 277.A N GLY 273.A O no hydrogen 2.818 N/A SER 277.A OG GLY 273.A O no hydrogen 3.297 N/A SER 277.A OG VAL 274.A O no hydrogen 3.464 N/A SER 277.A OG SER 289.A OG no hydrogen 2.770 N/A SER 278.A N VAL 274.A O no hydrogen 2.886 N/A SER 278.A OG VAL 274.A O no hydrogen 2.883 N/A SER 278.A OG SER 289.A O no hydrogen 3.326 N/A SER 278.A OG SER 289.A OG no hydrogen 3.076 N/A PHE 279.A N LEU 275.A O no hydrogen 2.964 N/A THR 280.A N ARG 276.A O no hydrogen 3.088 N/A THR 280.A OG1 ARG 276.A O no hydrogen 2.566 N/A ASN 281.A ND2 ASN 153.A O no hydrogen 3.107 N/A ASN 281.A ND2 GLN 284.A O no hydrogen 2.956 N/A GLY 283.A N THR 280.A O no hydrogen 2.847 N/A GLN 284.A N ASN 281.A O no hydrogen 2.994 N/A GLN 284.A NE2 ASN 281.A O no hydrogen 3.172 N/A GLN 284.A NE2 PRO 327.A O no hydrogen 3.633 N/A CYS 288.A N VAL 285.A O no hydrogen 3.091 N/A CYS 288.A SG SER 277.A O no hydrogen 3.300 N/A CYS 288.A SG THR 280.A O no hydrogen 4.012 N/A SER 289.A N SER 277.A O no hydrogen 2.919 N/A SER 289.A OG SER 277.A OG no hydrogen 2.770 N/A SER 289.A OG SER 278.A OG no hydrogen 3.076 N/A SER 289.A OG SER 289.A O no hydrogen 2.637 N/A GLU 290.A N ASN 257.A O no hydrogen 3.133 N/A ARG 291.A N ASN 257.A O no hydrogen 3.146 N/A ARG 291.A NE LYS 256.A O no hydrogen 2.883 N/A ARG 291.A NH1 TYR 293.A OH no hydrogen 2.866 N/A ARG 291.A NH1 ARG 408.A O no hydrogen 3.039 N/A ARG 291.A NH1 VAL 409.A O no hydrogen 3.502 N/A ARG 291.A NH2 LYS 256.A O no hydrogen 2.904 N/A ARG 291.A NH2 VAL 409.A O no hydrogen 3.128 N/A VAL 292.A N HIS 395.A O no hydrogen 2.712 N/A TYR 293.A N ALA 259.A O no hydrogen 2.825 N/A VAL 294.A N ALA 397.A O no hydrogen 2.876 N/A GLU 295.A N VAL 261.A O no hydrogen 2.995 N/A ARG 296.A N PHE 399.A O no hydrogen 2.824 N/A ARG 296.A NE ASP 400.A OD1 no hydrogen 2.772 N/A ARG 296.A NH2 ASP 400.A OD2 no hydrogen 3.121 N/A ILE 298.A N GLU 295.A O no hydrogen 3.114 N/A PHE 299.A N ARG 296.A O no hydrogen 3.122 N/A PHE 302.A N ILE 298.A O no hydrogen 2.897 N/A VAL 303.A N PHE 299.A O no hydrogen 2.914 N/A ALA 304.A N GLU 300.A O no hydrogen 3.056 N/A ALA 305.A N ARG 301.A O no hydrogen 2.966 N/A LEU 306.A N PHE 302.A O no hydrogen 2.971 N/A LYS 307.A N VAL 303.A O no hydrogen 2.960 N/A GLU 308.A N ALA 304.A O no hydrogen 3.211 N/A GLN 309.A N ALA 305.A O no hydrogen 3.185 N/A ALA 310.A N LEU 306.A O no hydrogen 2.844 N/A GLN 311.A N LYS 307.A O no hydrogen 2.900 N/A GLN 311.A NE2 THR 353.A OG1 no hydrogen 3.092 N/A ALA 312.A N GLU 308.A O no hydrogen 3.156 N/A ALA 312.A N GLN 309.A O no hydrogen 3.143 N/A LEU 313.A N ALA 310.A O no hydrogen 3.184 N/A ARG 314.A N THR 324.A OG1 no hydrogen 2.910 N/A ARG 314.A NH1 GLN 311.A O no hydrogen 3.172 N/A GLY 316.A N MET 325.A O no hydrogen 3.050 N/A GLU 319.A N GLU 319.A OE1 no hydrogen 2.755 N/A ASP 320.A N ALA 317.A O no hydrogen 3.229 N/A ALA 322.A N ASP 320.A OD1 no hydrogen 2.742 N/A THR 323.A N ASP 320.A O no hydrogen 3.027 N/A THR 323.A OG1 ALA 317.A O no hydrogen 2.806 N/A THR 323.A OG1 ASP 320.A O no hydrogen 3.544 N/A THR 324.A N ARG 314.A O no hydrogen 2.789 N/A MET 325.A N ARG 314.A O no hydrogen 3.042 N/A LEU 328.A N ALA 368.A O no hydrogen 2.950 N/A ILE 329.A N GLN 284.A OE1 no hydrogen 2.982 N/A ARG 331.A NH1 ASP 365.A O no hydrogen 2.937 N/A ARG 331.A NH1 GLY 367.A O no hydrogen 2.779 N/A HIS 333.A N SER 330.A OG no hydrogen 2.828 N/A HIS 333.A NE2 PHE 390.A O no hydrogen 2.758 N/A ARG 334.A N SER 330.A O no hydrogen 2.974 N/A ARG 334.A NH2 PHE 369.A O no hydrogen 2.971 N/A ASP 335.A N ARG 331.A O no hydrogen 2.864 N/A LYS 336.A N GLY 332.A O no hydrogen 3.191 N/A VAL 337.A N HIS 333.A O no hydrogen 3.014 N/A LEU 338.A N ARG 334.A O no hydrogen 2.804 N/A SER 339.A N ASP 335.A O no hydrogen 3.068 N/A TYR 340.A N LYS 336.A O no hydrogen 3.052 N/A TYR 340.A OH GLU 387.A OE1 no hydrogen 2.694 N/A PHE 341.A N VAL 337.A O no hydrogen 2.880 N/A ARG 342.A N LEU 338.A O no hydrogen 3.016 N/A LEU 343.A N SER 339.A O no hydrogen 2.962 N/A ALA 344.A N TYR 340.A O no hydrogen 2.847 N/A VAL 345.A N PHE 341.A O no hydrogen 3.372 N/A GLU 346.A N ARG 342.A O no hydrogen 3.135 N/A GLU 347.A N LEU 343.A O no hydrogen 2.916 N/A GLY 348.A N VAL 345.A O no hydrogen 3.095 N/A ALA 349.A N ALA 344.A O no hydrogen 3.045 N/A THR 350.A N THR 376.A O no hydrogen 2.993 N/A VAL 352.A N ILE 374.A O no hydrogen 2.952 N/A GLY 355.A N THR 373.A OG1 no hydrogen 2.832 N/A PHE 360.A N ASP 365.A OD1 no hydrogen 2.785 N/A GLY 361.A N ASP 365.A OD2 no hydrogen 2.680 N/A ARG 364.A N ASP 362.A OD1 no hydrogen 3.035 N/A ARG 364.A NE ASP 362.A OD1 no hydrogen 2.958 N/A ARG 364.A NE ASP 362.A OD2 no hydrogen 3.324 N/A ARG 364.A NH2 ASP 362.A OD2 no hydrogen 2.868 N/A ASP 365.A N ASP 362.A O no hydrogen 2.893 N/A ASP 366.A N ALA 363.A O no hydrogen 2.753 N/A GLY 367.A N ARG 364.A O no hydrogen 3.130 N/A ALA 368.A N PRO 24.A O no hydrogen 2.917 N/A MET 371.A N GLY 356.A O no hydrogen 2.862 N/A THR 373.A N PRO 392.A O no hydrogen 2.811 N/A THR 373.A OG1 MET 371.A O no hydrogen 2.903 N/A ILE 374.A N THR 353.A O no hydrogen 3.255 N/A TRP 375.A N CYS 394.A O no hydrogen 2.964 N/A THR 376.A N THR 350.A O no hydrogen 3.163 N/A LEU 378.A N HIS 395.A NE2 no hydrogen 2.977 N/A ALA 382.A N PRO 379.A O no hydrogen 2.967 N/A ARG 383.A N GLU 347.A OE2 no hydrogen 2.862 N/A ARG 383.A NE GLU 387.A OE2 no hydrogen 2.831 N/A ARG 383.A NH2 GLU 387.A OE1 no hydrogen 2.883 N/A ARG 383.A NH2 GLU 387.A OE2 no hydrogen 3.555 N/A CYS 384.A N GLU 347.A OE1 no hydrogen 2.904 N/A CYS 384.A SG TYR 340.A O no hydrogen 3.584 N/A CYS 384.A SG GLU 347.A OE1 no hydrogen 3.439 N/A VAL 385.A N ALA 382.A O no hydrogen 3.216 N/A ARG 386.A N ARG 383.A O no hydrogen 3.060 N/A ARG 386.A NH1 ASP 380.A O no hydrogen 3.151 N/A ARG 386.A NH1 ASP 411.A OD2 no hydrogen 3.175 N/A ARG 386.A NH2 ASP 411.A OD1 no hydrogen 3.068 N/A GLU 387.A N ARG 383.A O no hydrogen 2.825 N/A ILE 389.A N GLU 290.A OE1 no hydrogen 2.873 N/A PHE 390.A N GLU 290.A OE2 no hydrogen 2.736 N/A VAL 393.A N GLY 391.A O no hydrogen 3.058 N/A CYS 394.A N THR 373.A O no hydrogen 3.230 N/A CYS 394.A SG SER 278.A OG no hydrogen 3.589 N/A HIS 395.A N GLU 290.A O no hydrogen 2.957 N/A ILE 396.A N TRP 375.A O no hydrogen 2.919 N/A ALA 397.A N VAL 292.A O no hydrogen 2.889 N/A PHE 399.A N VAL 294.A O no hydrogen 2.959 N/A ASP 400.A N GLU 404.A OE1 no hydrogen 2.892 N/A ASP 401.A N GLU 404.A OE1 no hydrogen 3.144 N/A GLU 404.A N ASP 401.A OD1 no hydrogen 3.158 N/A VAL 405.A N ASP 401.A O no hydrogen 3.029 N/A VAL 406.A N GLU 402.A O no hydrogen 3.194 N/A LYS 407.A N ALA 403.A O no hydrogen 3.290 N/A ARG 408.A N GLU 404.A O no hydrogen 2.998 N/A ARG 408.A NE ASP 380.A OD1 no hydrogen 3.426 N/A ARG 408.A NE ASP 380.A OD2 no hydrogen 2.707 N/A ARG 408.A NH1 PRO 398.A O no hydrogen 3.033 N/A ARG 408.A NH1 GLU 404.A OE2 no hydrogen 2.976 N/A ARG 408.A NH2 ASP 380.A OD1 no hydrogen 2.975 N/A VAL 409.A N VAL 405.A O no hydrogen 2.911 N/A ASN 410.A N VAL 406.A O no hydrogen 3.024 N/A ASN 410.A ND2 GLN 434.A O no hydrogen 3.002 N/A ASP 411.A N LYS 407.A O no hydrogen 2.920 N/A SER 412.A OG TYR 414.A O no hydrogen 3.389 N/A TYR 414.A N SER 412.A OG no hydrogen 3.049 N/A GLY 415.A N SER 460.A OG no hydrogen 2.754 N/A ALA 417.A N ASN 257.A OD1 no hydrogen 2.932 N/A ALA 418.A N ILE 439.A O no hydrogen 3.112 N/A SER 419.A N ALA 258.A O no hydrogen 3.068 N/A ILE 420.A N TRP 441.A O no hydrogen 2.861 N/A TRP 421.A N VAL 260.A O no hydrogen 2.807 N/A THR 422.A N ASN 443.A OD1 no hydrogen 3.057 N/A THR 422.A OG1 ASP 264.A OD1 no hydrogen 2.589 N/A THR 422.A OG1 ASP 264.A OD2 no hydrogen 3.382 N/A THR 423.A N ASP 264.A OD1 no hydrogen 3.232 N/A THR 423.A OG1 ASP 264.A O no hydrogen 2.736 N/A GLN 424.A N THR 422.A OG1 no hydrogen 3.065 N/A ARG 427.A N GLN 424.A OE1.B no hydrogen 3.299 N/A ARG 427.A NE ASP 264.A OD2 no hydrogen 3.122 N/A ARG 427.A NH1 ASP 264.A OD2 no hydrogen 3.087 N/A ARG 427.A NH2 GLU 402.A OE1 no hydrogen 2.549 N/A GLY 428.A N GLN 424.A O no hydrogen 2.982 N/A HIS 429.A N LEU 425.A O no hydrogen 3.492 N/A ARG 430.A N ALA 426.A O no hydrogen 2.913 N/A ARG 430.A NE GLU 402.A OE1 no hydrogen 3.438 N/A ARG 430.A NE GLU 402.A OE2 no hydrogen 2.748 N/A ARG 430.A NH1 GLN 424.A OE1.B no hydrogen 3.433 N/A ARG 430.A NH2 GLU 402.A OE1 no hydrogen 2.883 N/A ARG 430.A NH2 GLU 402.A OE2 no hydrogen 3.498 N/A VAL 431.A N ARG 427.A O no hydrogen 2.935 N/A ALA 432.A N GLY 428.A O no hydrogen 3.225 N/A LYS 433.A N HIS 429.A O no hydrogen 3.222 N/A GLN 434.A N VAL 431.A O no hydrogen 2.999 N/A GLN 434.A NE2 ARG 430.A O no hydrogen 2.946 N/A ILE 435.A N ALA 432.A O no hydrogen 3.303 N/A GLU 436.A N ASN 410.A OD1 no hydrogen 2.881 N/A THR 437.A N ILE 435.A O no hydrogen 2.983 N/A THR 437.A OG1 ILE 439.A O no hydrogen 2.886 N/A GLY 438.A N LEU 416.A O no hydrogen 2.874 N/A ILE 439.A N LEU 416.A O no hydrogen 3.298 N/A TRP 441.A N ALA 418.A O no hydrogen 2.883 N/A TRP 441.A NE1 VAL 447.A O no hydrogen 3.050 N/A ASN 443.A N ILE 420.A O no hydrogen 2.805 N/A ASN 443.A ND2 THR 422.A O no hydrogen 2.757 N/A TRP 445.A NE1 LEU 287.A O no hydrogen 2.875 N/A ARG 451.A N ASP 449.A OD1 no hydrogen 3.075 N/A ARG 451.A NE ASP 449.A OD1 no hydrogen 3.034 N/A ARG 451.A NH2 ASP 449.A OD2 no hydrogen 2.903 N/A THR 452.A N ASP 449.A O no hydrogen 3.085 N/A THR 452.A OG1 ASP 449.A O no hydrogen 2.727 N/A PHE 454.A N GLU 465.A O no hydrogen 2.754 N/A THR 457.A N GLY 415.A O no hydrogen 2.883 N/A THR 457.A OG1 GLY 415.A O no hydrogen 3.102 N/A THR 457.A OG1 GLU 436.A O no hydrogen 3.086 N/A LYS 458.A NZ SER 412.A O no hydrogen 3.241 N/A LYS 458.A NZ GLU 436.A OE1 no hydrogen 2.796 N/A LEU 459.A N ALA 413.A O no hydrogen 3.067 N/A SER 460.A N THR 457.A O no hydrogen 2.892 N/A SER 460.A OG GLY 254.A O no hydrogen 2.764 N/A LEU 462.A N PHE 251.A O no hydrogen 3.175 N/A ARG 464.A NH1 GLY 456.A O no hydrogen 3.041 N/A ARG 464.A NH1 GLY 463.A O no hydrogen 3.074 N/A GLU 465.A N PHE 454.A O no hydrogen 3.045 N/A GLY 466.A N SER 470.A OG no hydrogen 2.679 N/A GLY 467.A N LEU 450.A O no hydrogen 3.069 N/A HIS 469.A N GLY 466.A O no hydrogen 2.992 N/A SER 470.A N GLY 466.A O no hydrogen 3.432 N/A SER 470.A N GLY 467.A O no hydrogen 3.024 N/A LEU 471.A N GLY 467.A O no hydrogen 3.196 N/A ASP 472.A N ARG 468.A O no hydrogen 2.828 N/A PHE 473.A N HIS 469.A O no hydrogen 2.893 N/A TYR 474.A N SER 470.A O no hydrogen 3.051 N/A TYR 474.A OH GLU 465.A OE1 no hydrogen 2.695 N/A SER 475.A N ASP 472.A O no hydrogen 3.312 N/A SER 475.A OG LEU 471.A O no hydrogen 3.127 N/A GLU 476.A N LYS 141.A O no hydrogen 2.769 N/A THR 478.A N THR 139.A O no hydrogen 2.858 N/A ASN 479.A ND2 ASN 136.A OD1 no hydrogen 3.208 N/A VAL 480.A N TYR 137.A O no hydrogen 2.914 N/A CYS 481.A SG ASN 136.A OD1 no hydrogen 3.312 N/A VAL 482.A N ILE 135.A O no hydrogen 2.765 N/A ARG 483.A NE ALA 485.A O no hydrogen 2.956 N/A ARG 483.A NH2 ALA 485.A OXT no hydrogen 3.123 N/A ILE 484.A N GLU 133.A O no hydrogen 2.881 N/A ALA 485.A N GLU 133.A O no hydrogen 3.393 N/A